≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488182538 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488182538 |
| Sorrisos canónicos | CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCC |
| IUPAC Name | diheptyl benzene-1,2-dicarboxylate |
| InChIKey | JQCXWCOOWVGKMT-UHFFFAOYSA-N |
| INCHI | 1S/C22H34O4/c1-3-5-7-9-13-17-25-21(23)19-15-11-12-16-20(19)22(24)26-18-14-10-8-6-4-2/h11-12,15-16H,3-10,13-14,17-18H2,1-2H3 |
| SMILES isoméricas | CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCC |
| WGK Alemanha | 3 |
| RTECS | TI1090000 |
| Peso molecular | 362.5 |
| Beilstein | 2336623 |
| Reaxy-Rn | 2336623 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2336623&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Classe | Benzene and substituted derivatives |
| Subclass | Benzoic acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzoic acid esters |
| Alternative Parents | Benzoyl derivatives Dicarboxylic acids and derivatives Carboxylic acid esters Organooxygen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Benzoate ester - Benzoyl - Dicarboxylic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound |
| Descrição | This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid. |
| External Descriptors | diester - phthalate ester |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Data | Item |
|---|---|---|---|
 I2601033 | Certificate of Analysis | Sep 07, 2026 | D113355 |
| G2504120 | Certificate of Analysis | Jul 15, 2025 | D113355 |
| E2417414 | Certificate of Analysis | Mar 20, 2024 | D113355 |
| E2417424 | Certificate of Analysis | Mar 20, 2024 | D113355 |
| B2505129 | Certificate of Analysis | Jun 22, 2022 | D113355 |
| B2505132 | Certificate of Analysis | Jun 22, 2022 | D113355 |
| H2231424 | Certificate of Analysis | Jun 22, 2022 | D113355 |
| H2231431 | Certificate of Analysis | Jun 22, 2022 | D113355 |
| H2231432 | Certificate of Analysis | Jun 22, 2022 | D113355 |
| L2416710 | Certificate of Analysis | Jun 22, 2022 | D113355 |
| F2316976 | Certificate of Analysis | Mar 15, 2021 | D113355 |
| L2416661 | Certificate of Analysis | Mar 15, 2021 | D113355 |
| Solubilidade | Sparingly soluble in water |
|---|---|
| Índice de refração | 1.483-1.485 |
| Ponto de inflamação (°F) | 235.4 °F - closed cup |
| Ponto de inflamação (°C) | 113 °C - closed cup |
| Ponto de ebulição (°C) | 194-196°C |
| Ponto de fusão (°C) | -46°C |
| Peso molecular | 362.500 g/mol |
| XLogP3 | 8.000 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 16 |
| Exact Mass | 362.246 Da |
| Monoisotopic Mass | 362.246 Da |
| Topological Polar Surface Area | 52.600 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 344.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Leng Yue, Sun Yonghai, Huang Wei, Lv Chengyu, Cui Jingyan, Li Tiezhu, Wang Yongjun. (2021) Identification of dicyclohexyl phthalate as a glucocorticoid receptor antagonist by molecular docking and multiple in vitro methods. MOLECULAR BIOLOGY REPORTS, 48 (4): (3145-3154). [PMID:33881729] [10.1007/s11033-021-06303-2] |
